(phenylmethyl) N-[2-[2-bromoethyloxy(oxidanyl)phosphoryl]oxyethyl]-N-hexadecyl-carbamate

Systemtic Name: (phenylmethyl) N-[2-[2-bromoethyloxy(oxidanyl)phosphoryl]oxyethyl]-N-hexadecyl-carbamate Openeye Name: benzyl N-[2-[2-bromoethoxy(hydroxy)phosphoryl]oxyethyl]-N-hexadecyl-carbamate CAS Name: N-[2-[2-bromoethoxy(hydroxy)phosphoryl]oxyethyl]-N-hexadecylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[2-bromoethoxy(hydroxy)phosphoryl]oxyethyl]-N-hexadecylcarbamate Traditional Name: N-[2-[2-bromoethoxy(hydroxy)phosphoryl]oxyethyl]-N-cetyl-carbamic acid benzyl ester Formula: C28H49BrNO6P MolecularWeight: 606.569521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CCOP(=O)(O)OCCBr)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CCOP(=O)(O)OCCBr)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C28H49BrNO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-22-30(23-25-36-37(32,33)35-24-21-29)28(31)34-26-27-19-16-15-17-20-27/h15-17,19-20H,2-14,18,21-26H2,1H3,(H,32,33)